methanamine;4-methyl-6,7-dihydroquinazoline

C10H15N3 — CID 90872144

IUPACmethanamine;4-methyl-6,7-dihydroquinazoline
SMILESCN.Cc1ncnc2c1=CCCC=2
InChIInChI=1S/C9H10N2.CH5N/c1-7-8-4-2-3-5-9(8)11-6-10-7;1-2/h4-6H,2-3H2,1H3;2H2,1H3
InChIKeyUBFGADQJCXAINU-UHFFFAOYSA-N
MW177.25 g/mol
LogP-0.29
Rot. Bonds

About methanamine;4-methyl-6,7-dihydroquinazoline

methanamine;4-methyl-6,7-dihydroquinazoline (PubChem CID 90872144) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is methanamine;4-methyl-6,7-dihydroquinazoline.

Molecular Properties

Compound Namemethanamine;4-methyl-6,7-dihydroquinazoline
PubChem CID90872144
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC Namemethanamine;4-methyl-6,7-dihydroquinazoline
SMILESCN.Cc1ncnc2c1=CCCC=2
InChIInChI=1S/C9H10N2.CH5N/c1-7-8-4-2-3-5-9(8)11-6-10-7;1-2/h4-6H,2-3H2,1H3;2H2,1H3
InChIKeyUBFGADQJCXAINU-UHFFFAOYSA-N
XLogP-0.29
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 5-0.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of methanamine;4-methyl-6,7-dihydroquinazoline?
The IUPAC name of methanamine;4-methyl-6,7-dihydroquinazoline (CID 90872144) is methanamine;4-methyl-6,7-dihydroquinazoline.
What is the SMILES notation for methanamine;4-methyl-6,7-dihydroquinazoline?
The canonical SMILES for methanamine;4-methyl-6,7-dihydroquinazoline is CN.Cc1ncnc2c1=CCCC=2.
What is the InChIKey of methanamine;4-methyl-6,7-dihydroquinazoline?
The InChIKey is UBFGADQJCXAINU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2.CH5N/c1-7-8-4-2-3-5-9(8)11-6-10-7;1-2/h4-6H,2-3H2,1H3;2H2,1H3.
What are the key properties of methanamine;4-methyl-6,7-dihydroquinazoline?
methanamine;4-methyl-6,7-dihydroquinazoline has a molecular weight of 177.25 g/mol, XLogP of -0.29, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methanamine;4-methyl-6,7-dihydroquinazoline is sourced from PubChem (CID 90872144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).